2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole

C181H294N52O10S12 — CID 160668078

IUPAC2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole
SMILESCC(C)C1=NC=CC1.CC(C)C1=NC=NC1.CC(C)c1ccon1.CC(C)c1ccsn1.CC(C)c1cnc[nH]1.CC(C)c1cscn1.CC(C)c1ncco1.CC(C)c1nccs1.CC(C)c1ncno1.CC(C)c1ncns1.CC(C)c1ncon1.CC(C)c1ncsn1.CC(C)c1nn[nH]n1.CC(C)c1nnco1.CC(C)c1nncs1.CC(C)c1nnn(C)n1.CC1=CCC(C(C)C)=N1.CC1=NCC(C(C)C)=N1.Cc1cc(C(C)C)no1.Cc1cc(C(C)C)ns1.Cc1coc(C(C)C)n1.Cc1csc(C(C)C)n1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)no1.Cc1nc(C(C)C)ns1.Cc1ncc(C(C)C)[nH]1.Cc1nnc(C(C)C)o1.Cc1nnc(C(C)C)s1.Cc1noc(C(C)C)n1.Cc1nsc(C(C)C)n1
InChIInChI=1S/C8H13N.2C7H12N2.2C7H11NO.3C7H11NS.C7H11N.3C6H10N2O.3C6H10N2S.2C6H10N2.2C6H9NO.3C6H9NS.C5H10N4.3C5H8N2O.3C5H8N2S.C4H8N4/c1-6(2)8-5-4-7(3)9-8;2*1-5(2)7-4-8-6(3)9-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-4-6(3)9-8-7;1-5(2)7-4-9-6(3)8-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-4-6(3)9-8-7;1-6(2)7-4-3-5-8-7;1-4(2)6-8-7-5(3)9-6;1-4(2)6-7-5(3)9-8-6;1-4(2)6-7-5(3)8-9-6;1-4(2)6-8-7-5(3)9-6;1-4(2)6-7-5(3)9-8-6;1-4(2)6-7-5(3)8-9-6;2*1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-4(2)5-6-8-9(3)7-5;1-4(2)5-7-6-3-8-5;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-4(2)5-7-6-3-8-5;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-3(2)4-5-7-8-6-4/h4,6H,5H2,1-3H3;5H,4H2,1-3H3;4-5H,1-3H3,(H,8,9);5*4-5H,1-3H3;3,5-6H,4H2,1-2H3;6*4H,1-3H3;4-5H,3H2,1-2H3;3-5H,1-2H3,(H,7,8);5*3-5H,1-2H3;4H,1-3H3;6*3-4H,1-2H3;3H,1-2H3,(H,5,6,7,8)
InChIKeyRMOMIZKMGCNUMQ-UHFFFAOYSA-N
MW3743.50 g/mol
LogP52.37
Rot. Bonds30

About 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole

2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole (PubChem CID 160668078) has the molecular formula C181H294N52O10S12 and a molecular weight of 3743.50 g/mol. Its IUPAC name is 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole.

Molecular Properties

Compound Name2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole
PubChem CID160668078
Molecular FormulaC181H294N52O10S12
Molecular Weight3743.50 g/mol
Exact Mass3740.07
IUPAC Name2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole
SMILESCC(C)C1=NC=CC1.CC(C)C1=NC=NC1.CC(C)c1ccon1.CC(C)c1ccsn1.CC(C)c1cnc[nH]1.CC(C)c1cscn1.CC(C)c1ncco1.CC(C)c1nccs1.CC(C)c1ncno1.CC(C)c1ncns1.CC(C)c1ncon1.CC(C)c1ncsn1.CC(C)c1nn[nH]n1.CC(C)c1nnco1.CC(C)c1nncs1.CC(C)c1nnn(C)n1.CC1=CCC(C(C)C)=N1.CC1=NCC(C(C)C)=N1.Cc1cc(C(C)C)no1.Cc1cc(C(C)C)ns1.Cc1coc(C(C)C)n1.Cc1csc(C(C)C)n1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)no1.Cc1nc(C(C)C)ns1.Cc1ncc(C(C)C)[nH]1.Cc1nnc(C(C)C)o1.Cc1nnc(C(C)C)s1.Cc1noc(C(C)C)n1.Cc1nsc(C(C)C)n1
InChIInChI=1S/C8H13N.2C7H12N2.2C7H11NO.3C7H11NS.C7H11N.3C6H10N2O.3C6H10N2S.2C6H10N2.2C6H9NO.3C6H9NS.C5H10N4.3C5H8N2O.3C5H8N2S.C4H8N4/c1-6(2)8-5-4-7(3)9-8;2*1-5(2)7-4-8-6(3)9-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-4-6(3)9-8-7;1-5(2)7-4-9-6(3)8-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-4-6(3)9-8-7;1-6(2)7-4-3-5-8-7;1-4(2)6-8-7-5(3)9-6;1-4(2)6-7-5(3)9-8-6;1-4(2)6-7-5(3)8-9-6;1-4(2)6-8-7-5(3)9-6;1-4(2)6-7-5(3)9-8-6;1-4(2)6-7-5(3)8-9-6;2*1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-4(2)5-6-8-9(3)7-5;1-4(2)5-7-6-3-8-5;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-4(2)5-7-6-3-8-5;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-3(2)4-5-7-8-6-4/h4,6H,5H2,1-3H3;5H,4H2,1-3H3;4-5H,1-3H3,(H,8,9);5*4-5H,1-3H3;3,5-6H,4H2,1-2H3;6*4H,1-3H3;4-5H,3H2,1-2H3;3-5H,1-2H3,(H,7,8);5*3-5H,1-2H3;4H,1-3H3;6*3-4H,1-2H3;3H,1-2H3,(H,5,6,7,8)
InChIKeyRMOMIZKMGCNUMQ-UHFFFAOYSA-N
XLogP52.37
TPSA799.24 Ų
H-Bond Donors3
H-Bond Acceptors71
Rotatable Bonds30
Heavy Atoms255
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003743.50
LogP ≤ 552.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1071

Analyze 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole?
The IUPAC name of 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole (CID 160668078) is 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole.
What is the SMILES notation for 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole?
The canonical SMILES for 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole is CC(C)C1=NC=CC1.CC(C)C1=NC=NC1.CC(C)c1ccon1.CC(C)c1ccsn1.CC(C)c1cnc[nH]1.CC(C)c1cscn1.CC(C)c1ncco1.CC(C)c1nccs1.CC(C)c1ncno1.CC(C)c1ncns1.CC(C)c1ncon1.CC(C)c1ncsn1.CC(C)c1nn[nH]n1.CC(C)c1nnco1.CC(C)c1nncs1.CC(C)c1nnn(C)n1.CC1=CCC(C(C)C)=N1.CC1=NCC(C(C)C)=N1.Cc1cc(C(C)C)no1.Cc1cc(C(C)C)ns1.Cc1coc(C(C)C)n1.Cc1csc(C(C)C)n1.Cc1nc(C(C)C)cs1.Cc1nc(C(C)C)no1.Cc1nc(C(C)C)ns1.Cc1ncc(C(C)C)[nH]1.Cc1nnc(C(C)C)o1.Cc1nnc(C(C)C)s1.Cc1noc(C(C)C)n1.Cc1nsc(C(C)C)n1.
What is the InChIKey of 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole?
The InChIKey is RMOMIZKMGCNUMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N.2C7H12N2.2C7H11NO.3C7H11NS.C7H11N.3C6H10N2O.3C6H10N2S.2C6H10N2.2C6H9NO.3C6H9NS.C5H10N4.3C5H8N2O.3C5H8N2S.C4H8N4/c1-6(2)8-5-4-7(3)9-8;2*1-5(2)7-4-8-6(3)9-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-4-6(3)9-8-7;1-5(2)7-4-9-6(3)8-7;1-5(2)7-8-6(3)4-9-7;1-5(2)7-4-6(3)9-8-7;1-6(2)7-4-3-5-8-7;1-4(2)6-8-7-5(3)9-6;1-4(2)6-7-5(3)9-8-6;1-4(2)6-7-5(3)8-9-6;1-4(2)6-8-7-5(3)9-6;1-4(2)6-7-5(3)9-8-6;1-4(2)6-7-5(3)8-9-6;2*1-5(2)6-3-7-4-8-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-5(2)6-3-8-4-7-6;1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-8-7-6;1-4(2)5-6-8-9(3)7-5;1-4(2)5-7-6-3-8-5;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-4(2)5-7-6-3-8-5;1-4(2)5-6-3-8-7-5;1-4(2)5-6-3-7-8-5;1-3(2)4-5-7-8-6-4/h4,6H,5H2,1-3H3;5H,4H2,1-3H3;4-5H,1-3H3,(H,8,9);5*4-5H,1-3H3;3,5-6H,4H2,1-2H3;6*4H,1-3H3;4-5H,3H2,1-2H3;3-5H,1-2H3,(H,7,8);5*3-5H,1-2H3;4H,1-3H3;6*3-4H,1-2H3;3H,1-2H3,(H,5,6,7,8).
What are the key properties of 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole?
2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole has a molecular weight of 3743.50 g/mol, XLogP of 52.37, 30 rotatable bonds, 3 hydrogen bond donors, and 71 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-propan-2-yl-1H-imidazole;2-methyl-5-propan-2-yl-4H-imidazole;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;5-methyl-3-propan-2-yl-1,2,4-oxadiazole;4-methyl-2-propan-2-yl-1,3-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;5-methyl-2-propan-2-yl-3H-pyrrole;2-methyl-5-propan-2-yltetrazole;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-1,2,4-thiadiazole;5-methyl-3-propan-2-yl-1,2,4-thiadiazole;2-methyl-4-propan-2-yl-1,3-thiazole;4-methyl-2-propan-2-yl-1,3-thiazole;5-methyl-3-propan-2-yl-1,2-thiazole;5-propan-2-yl-1H-imidazole;5-propan-2-yl-4H-imidazole;2-propan-2-yl-1,3,4-oxadiazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;2-propan-2-yl-1,3-oxazole;3-propan-2-yl-1,2-oxazole;2-propan-2-yl-3H-pyrrole;5-propan-2-yl-2H-tetrazole;2-propan-2-yl-1,3,4-thiadiazole;3-propan-2-yl-1,2,4-thiadiazole;5-propan-2-yl-1,2,4-thiadiazole;2-propan-2-yl-1,3-thiazole;3-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole is sourced from PubChem (CID 160668078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).